SCHEMBL6826416

SCHEMBL6826416

N#CN=C1N=C(Cc2ccc(Cl)nc2)CS1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CHRNB2 P17787 1/20 0.44
CHRNA4 P43681 1/20 0.44
CHRNA1 P02708 1/20 0.35
AR P10275 1/20 0.33
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
POLB P06746 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14101253 0.77 CHRNA7 (0.45) CHRNA7MEN1KMT2ATDP1CHRNB2
Thiacloprid SCHEMBL26490 0.66 CHRNA7 (1.00) CHRNA7MEN1KMT2ATDP1CHRNB2
Thiacloprid SCHEMBL29412294 0.66 CHRNA7 (1.00) CHRNA7MEN1KMT2ATDP1CHRNB2
Thiacloprid SCHEMBL26491 0.66 CHRNA7 (1.00) CHRNA7MEN1KMT2ATDP1CHRNB2
Thiacloprid SCHEMBL237347 0.66 CHRNA7 (1.00) CHRNA7MEN1KMT2ATDP1CHRNB2
Thiacloprid SCHEMBL15757034 0.66 CHRNA7 (1.00) CHRNA7MEN1KMT2ATDP1CHRNB2
SCHEMBL7735963 0.66 CHRNA7 (0.60) CHRNA7MEN1KMT2ATDP1CHRNB2
Thiacloprid SCHEMBL30201546 0.65 CHRNA7 (0.72) CHRNA7MEN1KMT2ATDP1CHRNB2
Thiacloprid SCHEMBL27503321 0.65 CHRNA7 (0.98) CHRNA7MEN1KMT2ATDP1CHRNB2
SCHEMBL5833216 0.64 CHRNA7 (0.61) CHRNA7MEN1KMT2ATDP1CHRNB2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1385817-A2 MALONONITRILE COMPOUNDS AND THEIR USE AS PESTICIDES SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2004-02-04 EP disclosed
WO-2002090320-A2 MALONONITRILE COMPOUNDS AND THEIR USE AS PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-11-14 WO disclosed